O1-methyl O5-(phenylmethyl) (2S)-2-[(4-methoxy-2-oxidanyl-3-propan-2-yloxy-phenyl)methylamino]pentanedioate

Systemtic Name: O1-methyl O5-(phenylmethyl) (2S)-2-[(4-methoxy-2-oxidanyl-3-propan-2-yloxy-phenyl)methylamino]pentanedioate Openeye Name: O5-benzyl O1-methyl (2S)-2-[(2-hydroxy-3-isopropoxy-4-methoxy-phenyl)methylamino]pentanedioate CAS Name: (2S)-2-[(2-hydroxy-4-methoxy-3-propan-2-yloxyphenyl)methylamino]pentanedioic acid O1-methyl ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 1-O-methyl (2S)-2-[(2-hydroxy-4-methoxy-3-propan-2-yloxyphenyl)methylamino]pentanedioate Traditional Name: (2S)-2-[(2-hydroxy-3-isopropoxy-4-methoxy-benzyl)amino]glutaric acid O5-benzyl ester O1-methyl ester Formula: C24H31NO7 MolecularWeight: 445.50544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1O)CNC(CCC(=O)OCC2=CC=CC=C2)C(=O)OC)OC

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1O)CN[C@@H](CCC(=O)OCC2=CC=CC=C2)C(=O)OC)OC

InChI

InChI=1S/C24H31NO7/c1-16(2)32-23-20(29-3)12-10-18(22(23)27)14-25-19(24(28)30-4)11-13-21(26)31-15-17-8-6-5-7-9-17/h5-10,12,16,19,25,27H,11,13-15H2,1-4H3/t19-/m0/s1